BDBM50001036 3-(3-Chloro-allyl)-6,11-dimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-benzo[d]azocin-8-ol::CHEMBL2367791

SMILES: [H][C@]12Cc3ccc(O)cc3[C@@](C)(CCN1C\C=C\Cl)[C@H]2C

InChI Key: InChIKey=VMYJIECAXKQMIN-OQDBKBFPSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50001036   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50001036 (3-(3-Chloro-allyl)-6,11-dimethyl-1,2,3,4,5,6-hexah...) Show SMILES [H][C@]12Cc3ccc(O)cc3[C@@](C)(CCN1C\C=C\Cl)[C@H]2C |THB:8:9:19:14.12.13,15:14:19:9.3.2| Show InChI InChI=1S/C17H22ClNO/c1-12-16-10-13-4-5-14(20)11-15(13)17(12,2)6-9-19(16)8-3-7-18/h3-5,7,11-12,16,20H,6,8-10H2,1-2H3/b7-3+/t12-,16+,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Binding affinity against opioid receptor mu using [3H]-DAMGO as radioligand.				J Med Chem 35: 2812-8 (1992) BindingDB Entry DOI: 10.7270/Q29W0G3H
					More data for this Ligand-Target Pair